4-(2-Methylpropanamido)benzene-1-sulfonyl chloride
TL;DR: 4-(2-Methylpropanamido)benzene-1-sulfonyl chloride (CAS 114063-95-5) is a chemical compound with molecular formula C10H12ClNO3S and molecular weight 261.02264 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
4-(2-methylpropanoylamino)benzenesulfonyl chloride
Also Known As: 4-(2-METHYLPROPANAMIDO)BENZENE-1-SULFONYL CHLORIDE, 4-(2-methylpropanoylamino)benzenesulfonyl chloride, 4-(2-METHYLPROPANAMIDO)BENZENESULFONYL CHLORIDE, 4-(2-METHYLPROPANAMIDO)BENZENE-1-SULFONYLCHLORIDE, G51048
Technical Specifications
| Molecular Formula | C10H12ClNO3S |
| Molecular Weight | 261.02264 g/mol |
| XLogP | 2.4 |
| Topological Polar Surface Area (TPSA) | 71.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 261.02264 Da |
| Heavy Atoms | 16 |
| Complexity | 340.0 |
| SMILES | CC(C)C(=O)NC1=CC=C(C=C1)S(=O)(=O)Cl |
| InChIKey | NEGMKGRTTKHKFH-UHFFFAOYSA-N |
Chemical Property Profile of 4-(2-Methylpropanamido)benzene-1-sulfonyl chloride
Property Insights of 4-(2-Methylpropanamido)benzene-1-sulfonyl chloride
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-(2-Methylpropanamido)benzene-1-sulfonyl chloride. The TPSA of 71.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 4-(2-Methylpropanamido)benzene-1-sulfonyl chloride. Following Lipinski's Rule of Five, 4-(2-Methylpropanamido)benzene-1-sulfonyl chloride has 1 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 4-(2-Methylpropanamido)benzene-1-sulfonyl chloride?
The CAS number of 4-(2-Methylpropanamido)benzene-1-sulfonyl chloride is 114063-95-5.
What is the molecular formula of 4-(2-Methylpropanamido)benzene-1-sulfonyl chloride?
The molecular formula of 4-(2-Methylpropanamido)benzene-1-sulfonyl chloride is C10H12ClNO3S.
What is the molecular weight of 4-(2-Methylpropanamido)benzene-1-sulfonyl chloride?
The molecular weight of 4-(2-Methylpropanamido)benzene-1-sulfonyl chloride is 261.02264 g/mol.
Where can I buy 4-(2-Methylpropanamido)benzene-1-sulfonyl chloride?
You can request a quote for 4-(2-Methylpropanamido)benzene-1-sulfonyl chloride directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 4-(2-Methylpropanamido)benzene-1-sulfonyl chloride?
Yes, CoreyChem provides custom synthesis services for 4-(2-Methylpropanamido)benzene-1-sulfonyl chloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.